2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl 2-oxidanylidenechromene-3-carboxylate

Systemtic Name: 2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl 2-oxidanylidenechromene-3-carboxylate Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]ethyl 2-oxochromene-3-carboxylate CAS Name: 2-oxo-1-benzopyran-3-carboxylic acid 2-[4-(benzenesulfonyl)-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]ethyl 2-oxochromene-3-carboxylate Traditional Name: 2-ketochromene-3-carboxylic acid 2-(4-besylpiperazino)ethyl ester Formula: C22H22N2O6S MolecularWeight: 442.48488

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC(=O)C2=CC3=CC=CC=C3OC2=O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCOC(=O)C2=CC3=CC=CC=C3OC2=O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H22N2O6S/c25-21(19-16-17-6-4-5-9-20(17)30-22(19)26)29-15-14-23-10-12-24(13-11-23)31(27,28)18-7-2-1-3-8-18/h1-9,16H,10-15H2